Fe-V-N稀合金中空位复合体特性的研究(Ⅱ)

本文利用离散变分法,集团模型和三维数值弛豫技术,研究了Fe-V-N稀合金中V-N-空位复合体的几何构型,正电子湮没特性和电子结构。根据正电子湮没寿命实验的结果和总能量极小原理,确定了V和N在V-N-空位复合体中的最佳占据位置。分析了V-N-空位复合体的成键特性和电荷转移情况。 关键词：     

Simulation of Vacuum Microelectronic Triode Made of Single Carbon Nanotube

Vacuum microelectronic triode performance, based upon a unit cell with a nanotube field emitter, gate, and anode, was evaluated via computer simulation. Electron emission was calculated from the modified Fowler-Nordheim equation. The dependence of emitted current, upon geometrical factors, e.g., nanotube radius, nanotube height, and gate's hole radius, is shown. The device design parameters of trans-conductance, and cutoff frequency have been calculated, which show that this structure can be used as a microwave and millimeter wave amplifier. Electron current flux is shown for time-dependent 1–Thz sinusoidal variation frequency input.     

变系数计量经济学联立模型的局部线性工具向量估计及其性质

联立方程计量经济学模型在经济政策制定、经济结构分析和经济预测方面起着重要作用。本文首次提出了我国宏观经济的一类变系数联立模型,并建立了函数系数的局部线性工具向量估计,同时在时间点列固定设计、经济变量随机设计条件下,研究了估计量的大样本性质。与我国宏观经济经典线性联立模型相比,变系数联立模型拟合效果更优。另外它也有助于克服我国宏观经济数据不多而造成的非参数方法应用困难的现实情况。     

Characteristics and structures of weak efficient surfaces of production possibility sets

This paper studies the characteristics and structure of the weak surface of the production possibility set. We apply techniques and methods of transferring a polyhedral cone from its intersection form to its sum form, identify an intersection representation of the production possibility set. We give the structure theorem of weak surface of the production possibility set, which includes three complementary slackness conditions. We define the input weak efficiency and output weak efficiency for different DEA models according to the representation of the intersection form. It investigates the characteristics of the weak surfaces, and proves the structure theorems of input weak DEA efficiency and output weak DEA efficiency. The structure theorems establish weighted combination of inputs and outputs that are weak DEA efficient. Numerical examples are provided for illustration.     

湖南省各市州经济发展水平评价

本文利用主成分分析法分析了湖南各市州的经济发展水平和经济综合实力,对湖南省14个市州的经济发展情况做出综合评价,得出了各市州在湖南省的经济地位.最后用系统聚类分析法进行了验证,结果表明用多元统计分析法来评价地区经济发展水平是可行的.     

The role of variable surface charge and surface complexation in the adsorption of humic acid on magnetite

The ionic strength dependence of humic acid (HA) adsorption on magnetite (Fe₃O₄) was investigated at pH 5, 8 and 9, where variable charged magnetite is positive, neutral and negative, respectively. The adsorption studies revealed that HA has high affinity to magnetite surface especially at lower pH, where interacting partners have opposite charges. However, in spite of electrostatic repulsion at pH 9 notable amounts of humate are adsorbed. Increasing ionic strength enhances HA adsorption at each pH due to charge screening. The dominant interaction is probably a ligand-exchange reaction, nevertheless the Coulombic contribution to the organic matter accumulation on oxide surface is also significant under acidic condition. The results from size exclusion chromatography demonstrate that the smaller size HA fractions enriched with functional groups are adsorbed preferentially on the surface of magnetite at pH 8 in dilute NaCl solution.     

链形线性元件电路的解题技巧

对一线性电路,若输入端的电压或电流变化,则组成电路中线性元件的电压、电流也将成比例地变化.所以,可假设输出端的电压或电流为一容易计算的值,逐步向前推导.推出假设的输入电压或电流,最后与实际电压或电流立一正比例式,即可求解.     

半连续格的刻画和映射

本文讨论了半连续格的一些性质,在半连续格中引入半Scott开集族,用半Scott开集族来刻画半连续格,同时定义了半连续格之间的半连续映射,得到闭包算子的像仍是半连续格的条件.最后,研究了半连续格上的半连续映射的全体不动点之集的性质。     

药用植物化学分类法与红外指纹图谱的相关性研究

本文首次采用傅里叶变换红外光谱法(FTIR)对五加科、桔梗科、木兰科、樟科、豆科、蕨类等科目中的典型药用植物进行了系统研究,比较了各科内植物的异同,并且讨论了相同植物不同药用部位、不同采药时间对其红外谱图的影响。结合药典中关于药物主体有效成分的记载,分析了各药用植物谱图中主要成分的特征基团,对主要吸收峰进行了指认。在传统形态比较分类方法的基础上,FTIR可以成为一种快速、可靠、客观、有效的化学分类学的补充方法。     

PuN基态分子势能函数与热力学函数的理论计算

在Pu的相对论有效原子实势近似和N原子 6 - 311G 全电子基函数下 ,用密度泛函B3LYP方法计算得到PuN分子基态X6Σ+ 的结构与势能函数、力常数与光谱数据 .同时计算得到PuN(g)分子在 2 98K时的标准生成热力学函数ΔfH0 、ΔS0 和ΔfG0 ,分别为 - 4 87.2 39kJ/mol、95 .345J/molK和 - 5 15 .6 6 6 1kJ/mol.